Vitas-M small molecule compound

N-[4-(acetylamino)phenyl]-2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK583308
SMILES COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)NC(=O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C25H22ClN5O3S MW 508.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O3S/c1-16(32)27-19-8-10-20(11-9-19)28-23(33)15-35-25-30-29-24(17-4-3-5-22(14-17)34-2)31(25)21-12-6-18(26)7-13-21/h3-14H,15H2,1-2H3,(H,27,32)(H,28,33)
InChIKey
LSWZANIAUZUFGX-UHFFFAOYSA-N
Synonyms
861147-23-1
2((4(4CHLOROPHENYL)5(3METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(4ACETAMIDOPHENYL)ACETAMIDE
861147231
CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)OC
InChI=1SC25H22ClN5O3Sc116(32)271981020(11919)2823(33)153525302924(1743522(1417)342)31(25)2112618(26)71321h314H15H212H3(H2732)(H2833)
MFCD04909091
N(4(acetylamino)phenyl)2((4(4chlorophenyl)5(3methoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(4(ACETYLAMINO)PHENYL)2(4(4CHLOROPHENYL)5(3METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(4ACETAMIDOPHENYL)2((4(4CHLOROPHENYL)5(3METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4acetamidophenyl)2((4(4chlorophenyl)5(3methoxyphenyl)4H124triazol3yl)thio)acetamide
ZINC000009308187
ZINC09308187
ZINC9308187

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.